1-(furan-3-ylmethyl)-4-pyridin-1-ium-2-yl-piperazine

Systemtic Name: 1-(furan-3-ylmethyl)-4-pyridin-1-ium-2-yl-piperazine Openeye Name: 1-(3-furylmethyl)-4-pyridin-1-ium-2-yl-piperazine CAS Name: 1-(3-furanylmethyl)-4-(2-pyridin-1-iumyl)piperazine IUPAC Name: 1-(furan-3-ylmethyl)-4-pyridin-1-ium-2-ylpiperazine Traditional Name: 1-(3-furfuryl)-4-pyridin-1-ium-2-yl-piperazine Formula: C14H18N3O+ MolecularWeight: 244.31222

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=COC=C2)C3=CC=CC=[NH+]3

Isomeric SMILES

C1CN(CCN1CC2=COC=C2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C14H17N3O/c1-2-5-15-14(3-1)17-8-6-16(7-9-17)11-13-4-10-18-12-13/h1-5,10,12H,6-9,11H2/p+1